5KTW
CREBBP bromodomain in complex with Cpd 44 (3-((5-acetyl-1-(cyclopropylmethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)amino)-N-isopropylbenzamide)
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C | CREB-binding protein | polymer | 114 | 13545.5 | 3 | UniProt (Q92793) Pfam (PF00439) In PDB | Homo sapiens (Human) | |
| 2 | A, B, C | 3-[[1-(cyclopropylmethyl)-5-ethanoyl-6,7-dihydro-4~{H}-pyrazolo[4,3-c]pyridin-3-yl]amino]-~{N}-propan-2-yl-benzamide | non-polymer | 395.5 | 3 | Chemie (6XG) | |||
| 3 | A, B, C | 1,2-ETHANEDIOL | non-polymer | 62.1 | 8 | Chemie (EDO) | |||
| 4 | water | water | 18.0 | 593 | Chemie (HOH) |
Sequence modifications
A, B, C: 1085 - 1196 (UniProt: Q92793)
| PDB | External Database | Details |
|---|---|---|
| Ala 1083 | - | expression tag |
| Ala 1084 | - | expression tag |
| Ala 1195 | Ser 1195 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 40636.4 | |
| Non-Polymers* | Number of molecules | 11 |
| Total formula weight | 1683.0 | |
| All* | Total formula weight | 42319.4 |
